1-(3-bromanyl-2-oxidanylidene-propyl)-N-(phenylmethyl)pyridin-1-ium-4-carboxamide

Systemtic Name: 1-(3-bromanyl-2-oxidanylidene-propyl)-N-(phenylmethyl)pyridin-1-ium-4-carboxamide Openeye Name: N-benzyl-1-(3-bromo-2-oxo-propyl)pyridin-1-ium-4-carboxamide CAS Name: 1-(3-bromo-2-oxopropyl)-N-(phenylmethyl)-4-pyridin-1-iumcarboxamide IUPAC Name: N-benzyl-1-(3-bromo-2-oxopropyl)pyridin-1-ium-4-carboxamide Traditional Name: N-benzyl-1-(3-bromo-2-keto-propyl)pyridin-1-ium-4-carboxamide Formula: C16H16BrN2O2+ MolecularWeight: 348.21444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CC=[N+](C=C2)CC(=O)CBr

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CC=[N+](C=C2)CC(=O)CBr

InChI

InChI=1S/C16H15BrN2O2/c17-10-15(20)12-19-8-6-14(7-9-19)16(21)18-11-13-4-2-1-3-5-13/h1-9H,10-12H2/p+1